[3-benzoyloxy-2,2-bis(benzoyloxymethyl)propyl] benzoate

About This Item

Molecular Formula	C₃₃H₂₈O₈
CAS Number	4196-86-5
Appearance	2,2-bis((benzoyloxy)methyl)dibenzoate-1,3-propanediol is a cream-colored solid. (NTP, 1992)

FC-0047663

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Properties

Chemical Identifiers

IUPAC Name	[3-benzoyloxy-2,2-bis(benzoyloxymethyl)propyl] benzoate
SMILES	C1=CC=C(C=C1)C(=O)OCC(COC(=O)C2=CC=CC=C2)(COC(=O)C3=CC=CC=C3)COC(=O)C4=CC=CC=C4
InChI Key	MINJAOUGXYRTEI-UHFFFAOYSA-N
InChI	InChI=1S/C33H28O8/c34-29(25-13-5-1-6-14-25)38-21-33(22-39-30(35)26-15-7-2-8-16-26,23-40-31(36)27-17-9-3-10-18-27)24-41-32(37)28-19-11-4-12-20-28/h1-20H,21-24H2

Physical Properties

Boiling Point	684.3ºC at 760 mmHg
Melting Point	207 to 212 °F (NTP, 1992)
Flash Point	286.2ºC
Density	1.2801 at 86 °F (NTP, 1992)

Safety Information

Hazard Class

Warning

Flash Point

286.2ºC

Please refer to the Safety Data Sheet (SDS) for complete handling, storage, and disposal instructions. Follow all applicable regulations when working with this chemical reagent.